CID 468639

Schembl3808259

Structural Information

Molecular Formula
C8H12N2O2
SMILES
CC(C)NNC(=O)C1=CC=CO1
InChI
InChI=1S/C8H12N2O2/c1-6(2)9-10-8(11)7-4-3-5-12-7/h3-6,9H,1-2H3,(H,10,11)
InChIKey
DFWWDQDEPCUABC-UHFFFAOYSA-N
Compound name
N'-propan-2-ylfuran-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

17
Patents

168.08987 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.09715 137.3
[M+Na]+ 191.07909 142.9
[M-H]- 167.08259 141.5
[M+NH4]+ 186.12369 157.3
[M+K]+ 207.05303 143.6
[M+H-H2O]+ 151.08713 131.0
[M+HCOO]- 213.08807 162.5
[M+CH3COO]- 227.10372 182.3
[M+Na-2H]- 189.06454 142.6
[M]+ 168.08932 137.2
[M]- 168.09042 137.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe